N,N-dimethyl-1-(2-methylpropyl)-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N,N-dimethyl-1-(2-methylpropyl)-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 5-(benzylamino)-1-isobutyl-N,N-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N,N-dimethyl-1-(2-methylpropyl)-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-(benzylamino)-N,N-dimethyl-1-(2-methylpropyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 5-(benzylamino)-1-isobutyl-N,N-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C21H30N4O MolecularWeight: 354.4891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)N(C)C

Isomeric SMILES

CC(C)CN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)N(C)C

InChI

InChI=1S/C21H30N4O/c1-15(2)14-25-19-11-10-17(22-13-16-8-6-5-7-9-16)12-18(19)20(23-25)21(26)24(3)4/h5-9,15,17,22H,10-14H2,1-4H3